SCHEMBL6927090

SCHEMBL6927090

CCNC(=O)c1sc2nc(SC)nc(-c3cccc(N)c3)c2c1N

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LHCGR P22888 9/20 0.64
TSHR P16473 2/20 0.61
FSHR P23945 2/20 0.56
BRAF P15056 4/20 0.49
PDE4A P27815 2/20 0.49
PDE4B Q07343 2/20 0.49
PDE4C Q08493 2/20 0.49
PDE4D Q08499 2/20 0.49
CHRM4 P08173 4/20 0.42
NPC1 O15118 1/20 0.41
HPGD P15428 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4331233 0.90 LHCGR (0.77) LHCGRTSHRFSHRBRAFPDE4A
SCHEMBL6928354 0.87 LHCGR (0.58) LHCGRTSHRFSHRBRAFCHRM4
SCHEMBL4421168 0.86 LHCGR (0.84) LHCGRTSHRFSHRBRAFPDE4A
SCHEMBL4421145 0.86 BRAF (0.62) LHCGRTSHRFSHRBRAFPDE4A
SCHEMBL5025967 0.86 LHCGR (0.62) LHCGRTSHRFSHRBRAFPDE4A
SCHEMBL4431522 0.84 LHCGR (0.62) LHCGRTSHRFSHRBRAFPDE4A
SCHEMBL6217958 0.81 CHRM4 (0.60) LHCGRTSHRFSHRCHRM4HPGD
SCHEMBL4325451 0.81 LHCGR (0.75) LHCGRTSHRFSHRBRAFPDE4A
SCHEMBL4322522 0.80 LHCGR (0.81) LHCGRTSHRFSHRBRAFPDE4A
SCHEMBL4331127 0.80 LHCGR (0.76) LHCGRTSHRFSHRBRAFPDE4A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6569863-B1 Luteinizing hormone (LH) agonists for controlling fertility AKZO NOBEL NV (NL) 2003-05-27 US disclosed